SCHEMBL16636880

SCHEMBL16636880

CC(C)(C)C1CN(c2nc(Cl)nc3cc(Cl)c(Br)cc23)CCN1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 1/20 0.35
SLC6A7 Q99884 1/20 0.35
HRH4 Q9H3N8 1/20 0.33
PTGFR P43088 1/20 0.33
ABL1 P00519 7/20 0.32
BCR P11274 7/20 0.32
KRAS P01116 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
LIMK2 P53671 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
PRKDC P78527 2/20 0.30
SMO Q99835 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16636893 0.90 HRH4 (0.38) SLC6A7HRH4PTGFRKRASLIMK2
SCHEMBL28997421 0.80 KRAS (0.38) SMN1; SMN2ALDH1A1ABL1BCRKRAS
SCHEMBL28997418 0.80 KRAS (0.38) SMN1; SMN2ALDH1A1ABL1BCRKRAS
SCHEMBL16637903 0.77 KRAS (0.36) SMN1; SMN2HRH4PTGFRKRASEGLN1
SCHEMBL22631353 0.76 ABL1 (0.45) SMN1; SMN2ALDH1A1ABL1BCRKRAS
SCHEMBL26612928 0.76 KRAS (0.39) SMN1; SMN2ALDH1A1ABL1BCRKRAS
SCHEMBL22631309 0.76 KRAS (0.39) SMN1; SMN2ALDH1A1ABL1BCRKRAS
SCHEMBL16636524 0.75 TLR9 (0.52) SMN1; SMN2ALDH1A1ABL1BCR
SCHEMBL16637134 0.75 HRH4 (0.39) SLC6A7HRH4KRASSMO
SCHEMBL28997225 0.75 KRAS (0.41) SMN1; SMN2KRAS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2025-02-25 US disclosed
US-20240352028-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2024-10-24 US disclosed
US-20240043441-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2024-02-08 US disclosed
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2024-01-23 US disclosed
US-20230303586-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-09-28 US disclosed
US-20230212183-A9 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-07-06 US disclosed
US-20220242875-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2022-08-04 US disclosed
US-20210188869-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2021-06-24 US disclosed
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2021-02-23 US disclosed
EP-3193851-B1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2020-10-21 EP disclosed
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2019-08-06 US disclosed
US-10111874-B2 Combination therapies for treatment of cancer ARAXES PHARMA LLC (US) 2018-10-30 US disclosed
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-05-03 US disclosed
US-9840516-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2017-12-12 US disclosed
EP-3193851-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER Araxes Pharma LLC (US) 2017-07-26 EP disclosed
EP-3055290-A1 INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2016-08-17 EP disclosed
US-20160166571-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC 2016-06-16 US disclosed
WO-2016044772-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2016-03-24 WO disclosed
US-20150239900-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2015-08-27 US disclosed
WO-2015054572-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2015-04-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210188869-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 1888/4885ALDH1A1 4178/4885SLC6A7 3167/4885
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 2196/4885ALDH1A1 2326/4885SLC6A7 1294/4885
US-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 2284/4885ALDH1A1 3870/4885SLC6A7 1416/4885
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 2243/4885ALDH1A1 4009/4885SLC6A7 2498/4885
US-20240352028-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 2243/4885ALDH1A1 4009/4885SLC6A7 2498/4885
US-10111874-B2 Combination therapies for treatment of cancer KRAS, TP53, HRAS SMN1; SMN2 3583/4885ALDH1A1 1577/4885SLC6A7 3107/4885
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 2243/4885ALDH1A1 4009/4885SLC6A7 2498/4885
US-20150239900-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 1888/4885ALDH1A1 4178/4885SLC6A7 3167/4885
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 2015/4885ALDH1A1 3675/4885SLC6A7 1995/4885
US-20230212183-A9 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 1888/4885ALDH1A1 4178/4885SLC6A7 3167/4885
US-20240043441-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 1888/4885ALDH1A1 4178/4885SLC6A7 3167/4885
US-20230303586-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 1888/4885ALDH1A1 4178/4885SLC6A7 3167/4885
US-20220242875-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 1888/4885ALDH1A1 4178/4885SLC6A7 3167/4885
US-20160166571-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER KRAS, TP53, HRAS SMN1; SMN2 3583/4885ALDH1A1 1577/4885SLC6A7 3107/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.